# generated using pymatgen data_Rb4(Mo7Se8)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 29.99462683 _cell_length_b 29.99462662 _cell_length_c 29.99462749 _cell_angle_alpha 18.71025953 _cell_angle_beta 18.71026075 _cell_angle_gamma 18.71026054 _symmetry_Int_Tables_number 1 _chemical_formula_structural Rb4(Mo7Se8)3 _chemical_formula_sum 'Rb8 Mo42 Se48' _cell_volume 2426.18647999 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Rb Rb0 1 0.34304585 0.34304585 0.34304585 1.0 Rb Rb1 1 0.10702006 0.10702006 0.10702006 1.0 Rb Rb2 1 0.46721713 0.46721713 0.46721713 1.0 Rb Rb3 1 0.89297994 0.89297994 0.89297994 1.0 Rb Rb4 1 0.41299671 0.41299671 0.41299671 1.0 Rb Rb5 1 0.58700329 0.58700329 0.58700329 1.0 Rb Rb6 1 0.65695415 0.65695415 0.65695415 1.0 Rb Rb7 1 0.53278287 0.53278287 0.53278287 1.0 Mo Mo8 1 0.15377625 0.02891198 0.34224589 1.0 Mo Mo9 1 0.20571087 0.01757450 0.89346159 1.0 Mo Mo10 1 0.15382786 0.97202638 0.83642820 1.0 Mo Mo11 1 0.20774146 0.07846863 0.39328313 1.0 Mo Mo12 1 0.73124170 0.59784275 0.91473908 1.0 Mo Mo13 1 0.86861710 0.55433909 0.74296303 1.0 Mo Mo14 1 0.64905661 0.96588801 0.78223331 1.0 Mo Mo15 1 0.96588801 0.78223331 0.64905661 1.0 Mo Mo16 1 0.79225854 0.92153137 0.60671687 1.0 Mo Mo17 1 0.02797362 0.16357180 0.84617214 1.0 Mo Mo18 1 0.39328313 0.20774146 0.07846863 1.0 Mo Mo19 1 0.92153137 0.60671687 0.79225854 1.0 Mo Mo20 1 0.55433909 0.74296303 0.86861710 1.0 Mo Mo21 1 0.59784275 0.91473908 0.73124170 1.0 Mo Mo22 1 0.13138290 0.44566091 0.25703697 1.0 Mo Mo23 1 0.98242550 0.10653841 0.79428913 1.0 Mo Mo24 1 0.74296303 0.86861710 0.55433909 1.0 Mo Mo25 1 0.91473908 0.73124170 0.59784275 1.0 Mo Mo26 1 0.65775411 0.84622375 0.97108802 1.0 Mo Mo27 1 0.84622375 0.97108802 0.65775411 1.0 Mo Mo28 1 0.79428913 0.98242550 0.10653841 1.0 Mo Mo29 1 0.97108802 0.65775411 0.84622375 1.0 Mo Mo30 1 0.07846863 0.39328313 0.20774146 1.0 Mo Mo31 1 0.25703697 0.13138290 0.44566091 1.0 Mo Mo32 1 0.97202638 0.83642820 0.15382786 1.0 Mo Mo33 1 0.02891198 0.34224589 0.15377625 1.0 Mo Mo34 1 0.34224589 0.15377625 0.02891198 1.0 Mo Mo35 1 0.89346159 0.20571087 0.01757450 1.0 Mo Mo36 1 0.78223331 0.64905661 0.96588801 1.0 Mo Mo37 1 0.08526092 0.26875830 0.40215725 1.0 Mo Mo38 1 0.26875830 0.40215725 0.08526092 1.0 Mo Mo39 1 0.44566091 0.25703697 0.13138290 1.0 Mo Mo40 1 0.60671687 0.79225854 0.92153137 1.0 Mo Mo41 1 0.35094339 0.03411199 0.21776669 1.0 Mo Mo42 1 0.21776669 0.35094339 0.03411199 1.0 Mo Mo43 1 0.10653841 0.79428913 0.98242550 1.0 Mo Mo44 1 0.03411199 0.21776669 0.35094339 1.0 Mo Mo45 1 0.16357180 0.84617214 0.02797362 1.0 Mo Mo46 1 0.40215725 0.08526092 0.26875830 1.0 Mo Mo47 1 0.01757450 0.89346159 0.20571087 1.0 Mo Mo48 1 0.83642820 0.15382786 0.97202638 1.0 Mo Mo49 1 0.84617214 0.02797362 0.16357180 1.0 Se Se50 1 0.26460326 0.51871756 0.89623790 1.0 Se Se51 1 0.30094445 0.30094445 0.30094445 1.0 Se Se52 1 0.67343983 0.29127405 0.92521460 1.0 Se Se53 1 0.10376210 0.73539674 0.48128244 1.0 Se Se54 1 0.89623790 0.26460326 0.51871756 1.0 Se Se55 1 0.32656017 0.70872595 0.07478540 1.0 Se Se56 1 0.56531930 0.94821155 0.31480785 1.0 Se Se57 1 0.57748989 0.21823634 0.96122899 1.0 Se Se58 1 0.42251011 0.78176366 0.03877101 1.0 Se Se59 1 0.84874241 0.21583594 0.46604860 1.0 Se Se60 1 0.31480785 0.56531930 0.94821155 1.0 Se Se61 1 0.72090855 0.33704153 0.98207729 1.0 Se Se62 1 0.52596737 0.16628356 0.90981361 1.0 Se Se63 1 0.78176366 0.03877101 0.42251011 1.0 Se Se64 1 0.92521460 0.67343983 0.29127405 1.0 Se Se65 1 0.21583594 0.46604860 0.84874241 1.0 Se Se66 1 0.68519215 0.43468070 0.05178845 1.0 Se Se67 1 0.53395140 0.15125759 0.78416406 1.0 Se Se68 1 0.96122899 0.57748989 0.21823634 1.0 Se Se69 1 0.84797241 0.84797241 0.84797241 1.0 Se Se70 1 0.47403263 0.83371644 0.09018639 1.0 Se Se71 1 0.07478540 0.32656017 0.70872595 1.0 Se Se72 1 0.03877101 0.42251011 0.78176366 1.0 Se Se73 1 0.48128244 0.10376210 0.73539674 1.0 Se Se74 1 0.93813267 0.93813267 0.93813267 1.0 Se Se75 1 0.73539674 0.48128244 0.10376210 1.0 Se Se76 1 0.69905555 0.69905555 0.69905555 1.0 Se Se77 1 0.01792271 0.27909145 0.66295847 1.0 Se Se78 1 0.15125759 0.78416406 0.53395140 1.0 Se Se79 1 0.06186733 0.06186733 0.06186733 1.0 Se Se80 1 0.83371644 0.09018639 0.47403263 1.0 Se Se81 1 0.94821155 0.31480785 0.56531930 1.0 Se Se82 1 0.15202759 0.15202759 0.15202759 1.0 Se Se83 1 0.98207729 0.72090855 0.33704153 1.0 Se Se84 1 0.90981361 0.52596737 0.16628356 1.0 Se Se85 1 0.51871756 0.89623790 0.26460326 1.0 Se Se86 1 0.27909145 0.66295847 0.01792271 1.0 Se Se87 1 0.66295847 0.01792271 0.27909145 1.0 Se Se88 1 0.29127405 0.92521460 0.67343983 1.0 Se Se89 1 0.46604860 0.84874241 0.21583594 1.0 Se Se90 1 0.05178845 0.68519215 0.43468070 1.0 Se Se91 1 0.70872595 0.07478540 0.32656017 1.0 Se Se92 1 0.09018639 0.47403263 0.83371644 1.0 Se Se93 1 0.33704153 0.98207729 0.72090855 1.0 Se Se94 1 0.43468070 0.05178845 0.68519215 1.0 Se Se95 1 0.78416406 0.53395140 0.15125759 1.0 Se Se96 1 0.16628356 0.90981361 0.52596737 1.0 Se Se97 1 0.21823634 0.96122899 0.57748989 1.0